4-[[(4E)-4-hydroxyimino-5-methyl-1,1-bis(oxidanylidene)-2,3-dihydrothiochromen-6-yl]carbonyl]-2-methyl-1H-pyrazol-3-one

Systemtic Name: 4-[[(4E)-4-hydroxyimino-5-methyl-1,1-bis(oxidanylidene)-2,3-dihydrothiochromen-6-yl]carbonyl]-2-methyl-1H-pyrazol-3-one Openeye Name: 4-[(4E)-4-hydroxyimino-5-methyl-1,1-dioxo-2,3-dihydrothiochromene-6-carbonyl]-2-methyl-1H-pyrazol-3-one CAS Name: 4-[[(4E)-4-hydroxyimino-5-methyl-1,1-dioxo-2,3-dihydro-1-benzothiopyran-6-yl]-oxomethyl]-2-methyl-1H-pyrazol-3-one IUPAC Name: 4-[(4E)-4-hydroxyimino-5-methyl-1,1-dioxo-2,3-dihydrothiochromene-6-carbonyl]-2-methyl-1H-pyrazol-3-one Traditional Name: 4-[(4E)-4-hydroximino-1,1-diketo-5-methyl-2,3-dihydrothiochromene-6-carbonyl]-2-methyl-3-pyrazolin-3-one Formula: C15H15N3O5S MolecularWeight: 349.3617

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1C(=NO)CCS2(=O)=O)C(=O)C3=CNN(C3=O)C

Isomeric SMILES

CC1=C(C=CC2=C1/C(=N/O)/CCS2(=O)=O)C(=O)C3=CNN(C3=O)C

InChI

InChI=1S/C15H15N3O5S/c1-8-9(14(19)10-7-16-18(2)15(10)20)3-4-12-13(8)11(17-21)5-6-24(12,22)23/h3-4,7,16,21H,5-6H2,1-2H3/b17-11+